N-[(E)-[1-(2-azanyl-2-oxidanylidene-ethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-3-bromanyl-benzamide

Systemtic Name: N-[(E)-[1-(2-azanyl-2-oxidanylidene-ethyl)-3-phenyl-pyrazol-4-yl]methylideneamino]-3-bromanyl-benzamide Openeye Name: N-[(E)-[1-(2-amino-2-oxo-ethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-3-bromo-benzamide CAS Name: N-[(E)-[1-(2-amino-2-oxoethyl)-3-phenyl-4-pyrazolyl]methylideneamino]-3-bromobenzamide IUPAC Name: N-[(E)-[1-(2-amino-2-oxoethyl)-3-phenylpyrazol-4-yl]methylideneamino]-3-bromobenzamide Traditional Name: N-[(E)-[1-(2-amino-2-keto-ethyl)-3-phenyl-pyrazol-4-yl]methyleneamino]-3-bromo-benzamide Formula: C19H16BrN5O2 MolecularWeight: 426.26664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC(=O)C3=CC(=CC=C3)Br)CC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)C3=CC(=CC=C3)Br)CC(=O)N

InChI

InChI=1S/C19H16BrN5O2/c20-16-8-4-7-14(9-16)19(27)23-22-10-15-11-25(12-17(21)26)24-18(15)13-5-2-1-3-6-13/h1-11H,12H2,(H2,21,26)(H,23,27)/b22-10+